Charge: -1
Inchi:1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H/q-1
Electronic States
Energy
(eV)
-844.31798
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.25900
Eigenvectors
#
X
Y
Z
1
0.00008
0.00000
-0.00014
2
-0.00008
0.00000
-0.00014
3
-0.00019
0.00000
0.00013
4
0.00038
0.00000
-0.00058
5
0.00019
0.00000
0.00013
6
-0.00038
0.00000
-0.00058
7
-0.00032
0.00000
0.00003
8
0.01310
0.00000
0.02751
9
0.00032
0.00000
0.00003
10
-0.01310
0.00000
0.02751
11
0.00465
0.00000
-0.00877
12
0.02147
0.00000
-0.03944
13
-0.00465
0.00000
-0.00877
14
-0.02147
0.00000
-0.03944
15
0.00317
0.00000
0.00030
16
0.01823
0.00000
0.00116
17
-0.00317
0.00000
0.00030
18
-0.01823
0.00000
0.00116
19
-0.00077
0.00000
0.00112
20
0.00077
0.00000
0.00112
21
0.00002
0.00000
0.00106
22
-0.00002
0.00000
0.00106
23
-0.03447
0.00000
-0.00057
24
-0.20073
0.00000
-0.00308
25
0.03447
0.00000
-0.00057
26
0.20073
0.00000
-0.00308
27
-0.05650
0.00000
0.09967
28
-0.26380
0.00000
0.44679
29
0.05650
0.00000
0.09967
30
0.26380
0.00000
0.44679
31
-0.16820
0.00000
-0.32160
32
0.16820
0.00000
-0.32160
33
0.00794
0.00000
-0.01139
34
-0.00794
0.00000
-0.01139